2-Butanone, 3-bromo- → Bromide ion

HRID 1133380Notes

Reaction equation

HRID 1133380 reaction equation
[Br:26][CH:27]([C:28]([CH3:29])=[O:30])[CH3:31].[NH2:1][c:2]1[n:3][n:4][c:5]([CH2:22][CH2:23][CH2:24][CH3:25])[n:6]1[CH2:7][c:8]1[cH:9][cH:10][c:11](-[c:14]2[c:15]([C:20]#[N:21])[cH:16][cH:17][cH:18][cH:19]2)[cH:12][cH:13]1>>[Br-:26].[NH2:1][c:2]1[n+:3]([CH:27]([C:28]([CH3:29])=[O:30])[CH3:31])[n:4][c:5]([CH2:22][CH2:23][CH2:24][CH3:25])[n:6]1[CH2:7][c:8]1[cH:9][cH:10][c:11](-[c:14]2[c:15]([C:20]#[N:21])[cH:16][cH:17][cH:18][cH:19]2)[cH:12][cH:13]1

Participants

4

Reactant 2

HCID 131422-Butanone, 3-bromo-HCID 100652943-amino-5-butyl-4-[(2'-cyanobiphenyl-4-yl)methyl]-4H-1,2,4-triazole

Product 2

HCID 259Bromide ionHCID 178441919HCID 178441919, compound

Sources & evidence

ORD record
ord-64b17da6469047efb9dcbb309cc68aae
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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